6K-592S
TL;DR: 6K-592S (CAS 338966-09-9) is a chemical compound with molecular formula C23H18ClFN2OS and molecular weight 424.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-3-(3,5-dimethylphenyl)-2-[(4-fluorophenyl)sulfanylmethyl]quinazolin-4-one
Also Known As: 6K-592S, 7-chloro-3-(3,5-dimethylphenyl)-2-[(4-fluorophenyl)sulfanylmethyl]quinazolin-4-one, 7-chloro-3-(3,5-dimethylphenyl)-2-{[(4-fluorophenyl)sulfanyl]methyl}-4(3H)-quinazolinone, 7-chloro-3-(3,5-dimethylphenyl)-2-{[(4-fluorophenyl)sulfanyl]methyl}-3,4-dihydroquinazolin-4-one
| Molecular Formula | C23H18ClFN2OS |
|---|---|
| Molecular Weight | 424.08 g/mol |
| LogP | 6.08734 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 424.08124 |
| Heavy Atoms | 29 |
| Complexity | 1248.3478 |
Chemical Identifiers
| CAS Number | 338966-09-9 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)N2C(=NC3=C(C2=O)C=CC(=C3)Cl)CSC4=CC=C(C=C4)F)C |
Product Overview
6K-592S (CAS 338966-09-9), with molecular formula C23H18ClFN2OS and molecular weight 424.08 g/mol. IUPAC: 7-chloro-3-(3,5-dimethylphenyl)-2-[(4-fluorophenyl)sulfanylmethyl]quinazolin-4-one.
Chemical Property Profile of 6K-592S
Property Insights of 6K-592S
The XLogP value of 6.08734 indicates that 6K-592S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 6K-592S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6K-592S has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6K-592S?
The CAS number of 6K-592S is 338966-09-9.
What is the molecular formula of 6K-592S?
The molecular formula of 6K-592S is C23H18ClFN2OS.
What is the molecular weight of 6K-592S?
The molecular weight of 6K-592S is 424.08 g/mol.
Where can I buy 6K-592S?
You can request a quote for 6K-592S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6K-592S?
Yes, KEHONG BIO provides custom synthesis services for 6K-592S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.